N-[[4-carbamimidoyl-2-[2-(2-morpholin-4-ylethylamino)-2-oxidanylidene-ethoxy]phenyl]methyl]-3-chloranyl-benzamide

Systemtic Name: N-[[4-carbamimidoyl-2-[2-(2-morpholin-4-ylethylamino)-2-oxidanylidene-ethoxy]phenyl]methyl]-3-chloranyl-benzamide Openeye Name: N-[[4-carbamimidoyl-2-[2-(2-morpholinoethylamino)-2-oxo-ethoxy]phenyl]methyl]-3-chloro-benzamide CAS Name: N-[[4-carbamimidoyl-2-[2-[2-(4-morpholinyl)ethylamino]-2-oxoethoxy]phenyl]methyl]-3-chlorobenzamide IUPAC Name: N-[[4-carbamimidoyl-2-[2-(2-morpholin-4-ylethylamino)-2-oxoethoxy]phenyl]methyl]-3-chlorobenzamide Traditional Name: N-[4-amidino-2-[2-keto-2-(2-morpholinoethylamino)ethoxy]benzyl]-3-chloro-benzamide Formula: C23H28ClN5O4 MolecularWeight: 473.95252

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)COC2=C(C=CC(=C2)C(=N)N)CNC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1COCCN1CCNC(=O)COC2=C(C=CC(=C2)C(=N)N)CNC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H28ClN5O4/c24-19-3-1-2-17(12-19)23(31)28-14-18-5-4-16(22(25)26)13-20(18)33-15-21(30)27-6-7-29-8-10-32-11-9-29/h1-5,12-13H,6-11,14-15H2,(H3,25,26)(H,27,30)(H,28,31)